1-methyl-4-nitro-1H-pyrazole-5-carbonitrile
Chemical Structure Depiction of
1-methyl-4-nitro-1H-pyrazole-5-carbonitrile
1-methyl-4-nitro-1H-pyrazole-5-carbonitrile
Compound characteristics
| Compound ID: | 0071-0010 |
| Compound Name: | 1-methyl-4-nitro-1H-pyrazole-5-carbonitrile |
| Molecular Weight: | 152.11 |
| Molecular Formula: | C5 H4 N4 O2 |
| Smiles: | Cn1c(C#N)c(cn1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 0.1809 |
| logD: | 0.1809 |
| logSw: | -0.4832 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 64.372 |
| InChI Key: | VNQXHRFFZAPFJI-UHFFFAOYSA-N |